SCHEMBL32677914

SCHEMBL32677914

O=C(C1CC1)C1C[C@H]2C=C[C@@H]1N(C(=O)OCc1ccccc1)C2

nearest known ligand 0.46

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.45
NPC1 O15118 2/20 0.45
RAB9A P51151 2/20 0.45
CYP2C19 P33261 1/20 0.44
PSEN1 P49768 2/20 0.41
PSEN2 P49810 2/20 0.41
APH1B Q8WW43 2/20 0.41
NCSTN Q92542 2/20 0.41
APH1A Q96BI3 2/20 0.41
PSENEN Q9NZ42 2/20 0.41
AGTR2 P50052 1/20 0.39
HTR2C P28335 1/20 0.39
ALDH1A1 P00352 1/20 0.39
GAA P10253 1/20 0.39
PREP P48147 2/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL32677920 1.00 SMN1; SMN2 (0.45) SMN1; SMN2NPC1RAB9ACYP2C19PSEN1
SCHEMBL32677918 1.00 SMN1; SMN2 (0.45) SMN1; SMN2NPC1RAB9ACYP2C19PSEN1
SCHEMBL32677917 1.00 SMN1; SMN2 (0.45) SMN1; SMN2NPC1RAB9ACYP2C19PSEN1
SCHEMBL32677922 1.00 SMN1; SMN2 (0.45) SMN1; SMN2NPC1RAB9ACYP2C19PSEN1
SCHEMBL13531488 0.88 SMN1; SMN2 (0.46) SMN1; SMN2NPC1RAB9ACYP2C19PSEN1
SCHEMBL9369927 0.84 CPB1 (0.47) SMN1; SMN2NPC1RAB9ACYP2C19PSEN1
SCHEMBL32677941 0.82 SMN1; SMN2 (0.43) SMN1; SMN2NPC1RAB9AAGTR2ALDH1A1
SCHEMBL32677942 0.82 SMN1; SMN2 (0.43) SMN1; SMN2NPC1RAB9AAGTR2ALDH1A1
SCHEMBL13888062 0.81 HTR2C (0.48) SMN1; SMN2NPC1RAB9ACYP2C19PSEN1
SCHEMBL14720538 0.80 PSEN1 (0.48) SMN1; SMN2NPC1RAB9ACYP2C19PSEN1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260055109-A1 IBOGAINE COMPOUNDS FOR TREATING BRAIN DISORDERS UNIV CALIFORNIA (US) 2026-02-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20260055109-A1 IBOGAINE COMPOUNDS FOR TREATING BRAIN DISORDERS HTR7, HTR3B, HTR3A SMN1; SMN2 982/4885NPC1 227/4885RAB9A 239/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.